SCHEMBL1371636

SCHEMBL1371636

C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NCC(O)Cc1ccccc1)C(N)=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 1/20 0.49
▸ HRH1 P35367 2/20 0.48
▸ GHSR Q92847 1/20 0.46
▸ MMP2 P08253 1/20 0.46
▸ CDYL2 Q8N8U2 1/20 0.45
▸ CDYL Q9Y232 1/20 0.45
▸ OPRK1 P41145 1/20 0.45
▸ PRSS1 P07477 1/20 0.44
▸ PRSS2 P07478 1/20 0.44
▸ PRSS3 P35030 1/20 0.44
▸ CTSL P07711 1/20 0.44
▸ GNPAT O15228 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1371634 0.86 FURIN (0.51) FURINHRH1GHSRCDYL2CDYL
SCHEMBL20964436 0.83 PRSS1 (0.61) FURINGHSRPRSS1PRSS2PRSS3
SCHEMBL1371635 0.83 MMP2 (0.55) MMP2OPRK1
SCHEMBL22268858 0.82 OPRK1 (0.52) FURINGHSRMMP2OPRK1GNPAT
SCHEMBL30818411 0.80 FURIN (0.57) FURINHRH1GHSRMMP2CDYL2
SCHEMBL29868240 0.79 OPRK1 (0.58) MMP2OPRK1GNPAT
SCHEMBL30977978 0.78 OPRK1 (0.55) MMP2OPRK1GNPAT
SCHEMBL30099540 0.78 MMP2 (0.56) FURINGHSRMMP2OPRK1CTSL
SCHEMBL22133739 0.77 GNPAT (0.52) FURINGHSRMMP2OPRK1GNPAT
SCHEMBL17725968 0.77 GHSR (0.68) GHSRCTSLGNPAT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160263235-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC (CA) 2016-09-15 — — US disclosed
EP-2794663-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF Angiochem Inc. (CA) 2014-10-29 — — EP disclosed
US-20110288011-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC. (CA) 2011-11-24 — — US disclosed
WO-2010063124-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF ANGIOCHEM INC. (CA) 2010-06-10 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160263235-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF VIP, SLC1A5, SLC47A1 FURIN 45/4885HRH1 2977/4885GHSR 1146/4885
US-20110288011-A1 PEPTIDE THERAPEUTIC CONJUGATES AND USES THEREOF VIP, SLC1A5, SLC47A1 FURIN 45/4885HRH1 2977/4885GHSR 1146/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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